SCHEMBL7771819

SCHEMBL7771819

C=CCCC(=O)C1=CCC2(CCCCC2)C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7776586 0.98 — —
SCHEMBL7771926 0.87 FAAH (0.31) —
SCHEMBL758157 0.85 FAAH (0.31) —
SCHEMBL16269372 0.85 FAAH (0.31) —
SCHEMBL11174692 0.76 MEN1 (0.34) MEN1KMT2A
SCHEMBL2313742 0.73 TSHR (0.38) —
SCHEMBL5708357 0.73 MEN1 (0.32) MEN1KMT2A
SCHEMBL7776631 0.73 MEN1 (0.30) POLBMEN1ALDH1A1KMT2A
SCHEMBL7771864 0.73 MEN1 (0.30) POLBMEN1ALDH1A1KMT2A
SCHEMBL112059 0.71 MEN1 (0.33) MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0913383-B1 New spirocyclic compounds GIVAUDAN SA (CH) 2001-09-05 — — EP claimed
US-6114300-A PERFUMES GIVAUDAN ROURE (INTERNATIONAL) SA (CH) 2000-09-05 — — US claimed
EP-0913383-A1 New spirocyclic compounds Givaudan Roure (International) S.A. (CH) 1999-05-06 — — EP claimed
EP-0913383-B1 New spirocyclic compounds GIVAUDAN SA (CH) 2001-09-05 — — EP disclosed
EP-0913383-A1 New spirocyclic compounds Givaudan Roure (International) S.A. (CH) 1999-05-06 — — EP disclosed
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